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Bromodomain Variator Dataset
The dataset used in this paper for rational design of reprogramming compounds - variators. The protocol used to identify promising candidates for the reprogramming of affinity... -
PDBbind v2018
The PDBbind v2018 dataset is a refined set of 4,186 protein-ligand complexes with their experimentally measured Kd values. -
BindingDB: a web-accessible database of experimentally determined protein-lig...
BindingDB is a database of experimentally determined protein-ligand binding affinities. -
Chembl: a large-scale bioactivity database for drug discovery
The Chembl database contains a large collection of bioactive molecules and their interactions with proteins.
